eon.prstate

eon.prstate#

The PRState module.

Module Contents#

Classes#

PRState

Data#

logger

API#

eon.prstate.logger#

‘getLogger(…)’

class eon.prstate.PRState(statepath, statenumber, statelist, previous_state_num=-1, reactant_path=None)#

Bases: eon.state.State

Initialization

Creates a new state, with lazily loaded data.

processtable_head_fmt#

‘%7s %9s %16s %12s\n’

processtable_header#

None

processtable_line#

‘%7d %9d %16.5f %12.5e\n’

search_result_header#

None

add_process(result)#

Adds a process to this state.

load_process_table()#

Load the process table. If the process table is not loaded, load it. If it is loaded, do nothing.

save_process_table()#

If the processtable is present in memory, writes it to disk.

append_process_table(id, product, product_energy, time)#

Append to the process table. Append a single line to the process table file. If we have loaded the process table, also append it to the process table in memory.

get_time()#
inc_time(timeinc)#
zero_time()#
Contents